4-methylsulfanyl-N-(2-methylsulfonylethyl)-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: 4-methylsulfanyl-N-(2-methylsulfonylethyl)-2-(2-phenoxyethanoylamino)butanamide Openeye Name: 4-methylsulfanyl-N-(2-methylsulfonylethyl)-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: N-(2-methylsulfonylethyl)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: 4-methylsulfanyl-N-(2-methylsulfonylethyl)-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: N-(2-mesylethyl)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C16H24N2O5S2 MolecularWeight: 388.50216

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCCS(=O)(=O)C)NC(=O)COC1=CC=CC=C1

Isomeric SMILES

CSCCC(C(=O)NCCS(=O)(=O)C)NC(=O)COC1=CC=CC=C1

InChI

InChI=1S/C16H24N2O5S2/c1-24-10-8-14(16(20)17-9-11-25(2,21)22)18-15(19)12-23-13-6-4-3-5-7-13/h3-7,14H,8-12H2,1-2H3,(H,17,20)(H,18,19)